SCHEMBL26082620

SCHEMBL26082620

CC(C)(C)NC(=O)CN1CCC(C(=O)NCc2ccc3ccccc3c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ TSHR P16473 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ HTT P42858 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ ACKR3 P25106 2/20 0.45
▸ THRB P10828 1/20 0.45
▸ POLB P06746 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL26082660 0.81 CACNA1I (0.60) ALDH1A1MEN1KMT2AACKR3
SCHEMBL23839974 0.78 CAPN1 (0.63) ACKR3THRB
SCHEMBL8083501 0.77 ERCC1 (0.65) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL26082659 0.76 CACNA1I (0.61) ALDH1A1KMT2AACKR3POLB
SCHEMBL26082619 0.74 EPHX2 (0.56) GAAHTTALDH1A1MEN1KMT2A
SCHEMBL13203840 0.73 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1MEN1KMT2AKDM4E
SCHEMBL10113306 0.73 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1MEN1KMT2AKDM4E
SCHEMBL19808535 0.73 IDO1 (0.52) SMN1; SMN2ALDH1A1MEN1KMT2AKDM4E
SCHEMBL26082621 0.73 ACKR3 (0.43) LMNASMN1; SMN2GAAHTTALDH1A1
SCHEMBL13003526 0.72 ALDH1A1 (0.53) LMNAALDH1A1ACKR3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023192687-A1 T-TYPE CALCIUM CHANNEL MODULATORS COMPRISING AN AZASPIROHEPTANE CORE AND METHODS OF USE THEREOF PRAXIS PRECISION MEDICINES, INC. (US) 2023-10-05 — — WO disclosed
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